#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e1c s LEU 25 N 0.00 4.36 0.76 2.45 1.43 -1.26 -5.09 118.68 121.32 2e1c s LEU 25 Ca 0.00 0.75 -0.04 0.00 -1.03 0.00 0.00 54.13 53.81 2e1c s LEU 25 Cb 0.00 -2.49 0.13 0.00 0.03 0.00 0.00 46.19 43.86 2e1c s LEU 25 CO 0.00 0.20 1.05 1.51 0.23 0.00 0.00 176.35 179.34 2e1c s ASP 26 N -0.26 4.18 0.35 2.29 1.47 -1.26 -4.91 116.67 118.54 2e1c s ASP 26 Ca 0.21 -0.20 0.06 0.00 1.18 0.00 0.00 52.55 53.80 2e1c s ASP 26 Cb -0.15 -0.15 0.73 0.00 -0.34 0.00 0.00 42.92 43.01 2e1c s ASP 26 CO 0.09 -1.98 1.94 -0.33 0.68 0.00 0.00 175.17 175.56 2e1c h GLU 27 N -0.71 0.76 -0.01 2.11 4.39 -1.99 -2.60 114.58 116.52 2e1c h GLU 27 Ca -0.38 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.27 2e1c h GLU 27 Cb 1.26 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.74 2e1c h GLU 27 CO 0.41 0.50 0.01 0.82 -1.16 0.00 0.00 179.01 179.59 2e1c h ILE 28 N 0.78 1.11 -0.93 3.13 1.08 -1.99 -1.49 117.51 119.20 2e1c h ILE 28 Ca 0.35 -0.32 0.05 0.00 -0.39 0.00 0.00 64.86 64.55 2e1c h ILE 28 Cb 0.33 1.30 -0.06 0.00 -3.07 0.00 0.00 36.82 35.32 2e1c h ILE 28 CO -0.13 0.08 0.60 0.44 -0.69 0.00 0.00 178.15 178.46 2e1c h ASP 29 N -0.11 0.96 -0.65 1.72 3.32 -1.85 -0.21 116.42 119.60 2e1c h ASP 29 Ca 0.00 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2e1c h ASP 29 Cb 0.13 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 2e1c h ASP 29 CO -0.00 0.63 0.13 0.11 -1.72 0.00 0.00 179.24 178.39 2e1c h LYS 30 N 1.10 1.08 -0.13 3.56 1.57 -1.19 0.79 116.57 123.35 2e1c h LYS 30 Ca 0.39 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2e1c h LYS 30 Cb 0.12 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2e1c h LYS 30 CO -0.14 0.98 0.05 0.87 -0.57 0.00 0.00 179.45 180.64 2e1c h LYS 31 N 1.02 0.19 -0.28 3.15 1.57 -0.26 -0.88 116.57 121.08 2e1c h LYS 31 Ca 0.21 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 59.01 2e1c h LYS 31 Cb 0.40 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.63 2e1c h LYS 31 CO 0.01 0.30 -0.05 0.82 -0.57 0.00 0.00 179.45 179.96 2e1c h ILE 32 N 0.04 0.74 -0.87 1.86 2.04 -0.73 -1.42 117.51 119.18 2e1c h ILE 32 Ca 0.04 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 2e1c h ILE 32 Cb 0.18 0.71 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 2e1c h ILE 32 CO -0.00 0.00 0.48 0.40 0.00 0.00 0.00 178.15 179.03 2e1c h ILE 33 N 0.02 1.25 -0.72 -0.67 2.04 -0.71 -1.18 117.51 117.54 2e1c h ILE 33 Ca 0.14 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 2e1c h ILE 33 Cb 0.20 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.33 2e1c h ILE 33 CO -0.27 0.28 0.29 0.50 0.00 0.00 0.00 178.15 178.95 2e1c h LYS 34 N 1.21 1.07 -0.34 2.37 3.64 -0.67 -0.75 116.57 123.11 2e1c h LYS 34 Ca 0.31 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 2e1c h LYS 34 Cb 0.03 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 2e1c h LYS 34 CO -0.05 0.88 -0.11 0.82 -2.27 0.00 0.00 179.45 178.72 2e1c h ILE 35 N 1.03 1.28 -0.07 2.00 2.04 -0.87 -2.81 117.51 120.11 2e1c h ILE 35 Ca 0.24 -1.18 -0.11 0.00 1.00 0.00 0.00 64.86 64.81 2e1c h ILE 35 Cb 0.20 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 2e1c h ILE 35 CO -0.02 0.39 -0.46 -0.07 0.00 0.00 0.00 178.15 177.99 2e1c h LEU 36 N 0.46 0.18 -0.46 1.44 3.38 -1.01 -0.88 115.31 118.42 2e1c h LEU 36 Ca 0.08 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2e1c h LEU 36 Cb 0.62 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2e1c h LEU 36 CO 0.04 0.62 -0.10 1.56 0.09 0.00 0.00 178.44 180.65 2e1c h GLN 37 N 0.14 0.88 -0.55 1.13 4.20 -1.14 -2.20 115.11 117.58 2e1c h GLN 37 Ca 0.01 -0.33 -0.07 0.00 0.06 0.00 0.00 58.65 58.32 2e1c h GLN 37 Cb 0.87 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.57 2e1c h GLN 37 CO 0.07 0.97 0.09 -0.97 -0.67 0.00 0.00 178.83 178.32 2e1c h ASN 38 N 0.73 0.88 -1.99 1.46 -0.73 -1.24 -3.41 115.58 111.28 2e1c h ASN 38 Ca 0.12 -0.26 -0.26 0.00 1.87 0.00 0.00 56.30 57.76 2e1c h ASN 38 Cb 0.64 -0.23 -0.31 0.00 0.27 0.00 0.00 38.32 38.68 2e1c h ASN 38 CO 0.04 0.92 -0.59 -0.62 -0.37 0.00 0.00 177.43 176.82 2e1c s ASP 39 N -6.31 1.09 0.18 1.15 2.15 -0.36 -5.02 116.67 109.55 2e1c s ASP 39 Ca -0.12 -0.51 0.11 0.00 0.43 0.00 0.00 52.55 52.46 2e1c s ASP 39 Cb 0.12 0.76 0.62 0.00 -0.30 0.00 0.00 42.92 44.13 2e1c s ASP 39 CO 0.82 -0.37 1.34 0.61 -0.17 0.00 0.00 175.17 177.40 2e1c n GLY 40 N 5.33 -0.68 0.93 2.66 0.00 -0.84 -1.32 105.19 111.27 2e1c n GLY 40 Ca -0.01 0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.20 2e1c n GLY 40 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e1c n LYS 41 N -1.90 2.54 -1.65 1.61 5.02 -1.26 -4.99 118.16 117.54 2e1c n LYS 41 Ca -0.01 -2.20 -0.48 0.00 -2.02 0.00 0.00 58.31 53.61 2e1c n LYS 41 Cb 0.04 -1.40 -0.05 0.00 -0.02 0.00 0.00 35.03 33.60 2e1c n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2e1c n ALA 42 N 1.05 0.77 -1.63 7.82 0.00 -0.44 -4.91 120.51 123.17 2e1c n ALA 42 Ca 0.16 0.45 -0.32 0.00 0.00 0.00 0.00 53.44 53.74 2e1c n ALA 42 Cb 0.51 -2.29 0.02 0.00 0.00 0.00 0.00 19.45 17.69 2e1c n ALA 42 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2e1c s PRO 43 N 1.00 3.18 0.36 0.00 0.04 -1.26 -4.93 135.00 133.40 2e1c s PRO 43 Ca 0.81 1.11 0.05 0.00 0.04 0.00 0.00 61.00 63.02 2e1c s PRO 43 Cb -0.75 -2.02 0.73 0.00 0.04 0.00 0.00 34.50 32.51 2e1c s PRO 43 CO 0.41 -0.91 1.97 -0.07 0.04 0.00 0.00 177.00 178.44 2e1c h LEU 44 N 0.03 0.66 -0.37 -3.56 3.38 -1.95 -2.01 115.31 111.50 2e1c h LEU 44 Ca -0.46 -0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.58 2e1c h LEU 44 Cb 1.22 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 2e1c h LEU 44 CO 0.57 0.44 0.00 -0.09 0.09 0.00 0.00 178.44 179.45 2e1c h ARG 45 N 0.76 0.10 0.09 1.13 2.43 -1.94 0.38 114.38 117.32 2e1c h ARG 45 Ca 0.29 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.45 2e1c h ARG 45 Cb 0.19 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2e1c h ARG 45 CO -0.09 0.07 -0.04 1.49 -1.51 0.00 0.00 179.97 179.88 2e1c h GLU 46 N 0.10 -0.11 -0.58 0.20 4.81 -1.76 -1.20 114.58 116.05 2e1c h GLU 46 Ca 0.18 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2e1c h GLU 46 Cb 0.25 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.63 2e1c h GLU 46 CO -0.30 0.06 0.20 0.82 -0.73 0.00 0.00 179.01 179.06 2e1c h ILE 47 N -0.26 1.22 0.31 2.32 2.04 -1.21 -1.79 117.51 120.13 2e1c h ILE 47 Ca -0.01 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 2e1c h ILE 47 Cb 0.22 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 2e1c h ILE 47 CO 0.02 0.28 -0.15 -1.28 0.00 0.00 0.00 178.15 177.02 2e1c h SER 48 N 0.84 -0.35 -0.65 1.72 0.87 -0.06 -1.07 113.55 114.85 2e1c h SER 48 Ca 0.20 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 2e1c h SER 48 Cb 0.21 0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.23 2e1c h SER 48 CO -0.01 -0.24 0.35 0.11 -0.53 0.00 0.00 176.83 176.51 2e1c h LYS 49 N -0.43 0.91 -0.19 2.24 1.79 -1.02 0.14 116.57 120.00 2e1c h LYS 49 Ca -0.04 -0.11 -0.10 0.00 -2.18 0.00 0.00 60.65 58.22 2e1c h LYS 49 Cb 0.33 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 2e1c h LYS 49 CO 0.07 0.70 -0.31 0.82 -1.08 0.00 0.00 179.45 179.65 2e1c h ILE 50 N 0.89 1.28 0.00 1.86 1.08 -1.27 -3.13 117.51 118.22 2e1c h ILE 50 Ca 0.23 -1.34 0.00 0.00 -0.39 0.00 0.00 64.86 63.36 2e1c h ILE 50 Cb 0.06 1.47 0.00 0.00 -3.07 0.00 0.00 36.82 35.27 2e1c h ILE 50 CO -0.04 0.42 -1.01 0.35 -0.69 0.00 0.00 178.15 177.18 2e1c n THR 51 N -4.09 0.36 -0.71 -0.27 -2.24 -0.41 -4.96 114.28 101.96 2e1c n THR 51 Ca -0.01 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 2e1c n THR 51 Cb 0.43 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 2e1c n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2e1c n GLY 52 N 1.28 0.79 3.90 3.38 0.00 0.46 -5.04 105.19 109.96 2e1c n GLY 52 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 2e1c n GLY 52 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2e1c s LEU 53 N 0.00 3.81 0.66 0.99 1.43 -0.99 -5.00 118.68 119.57 2e1c s LEU 53 Ca 0.00 -0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 52.65 2e1c s LEU 53 Cb 0.00 -2.46 -0.01 0.00 0.03 0.00 0.00 46.19 43.75 2e1c s LEU 53 CO 0.00 -0.32 1.07 0.00 0.23 0.00 0.00 176.35 177.33 2e1c s ALA 54 N -2.21 2.62 0.18 4.21 0.00 -1.26 -4.37 121.76 120.93 2e1c s ALA 54 Ca 0.41 0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 2e1c s ALA 54 Cb -0.08 -3.23 0.15 0.00 0.00 0.00 0.00 23.12 19.96 2e1c s ALA 54 CO 0.28 -1.13 1.79 0.93 0.00 0.00 0.00 175.76 177.63 2e1c h GLU 55 N -0.18 0.51 0.00 0.00 5.08 -1.93 -1.63 114.58 116.44 2e1c h GLU 55 Ca -0.45 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 57.84 2e1c h GLU 55 Cb 1.22 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 2e1c h GLU 55 CO 0.56 0.34 -0.17 0.66 -1.00 0.00 0.00 179.01 179.40 2e1c h SER 56 N 0.52 0.00 -0.34 1.42 4.64 -1.95 0.17 113.55 118.01 2e1c h SER 56 Ca 0.23 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.44 2e1c h SER 56 Cb 0.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2e1c h SER 56 CO -0.16 0.17 -0.23 0.74 -0.87 0.00 0.00 176.83 176.48 2e1c h THR 57 N 0.00 1.29 -0.42 2.95 2.02 -1.69 -1.86 112.91 115.20 2e1c h THR 57 Ca -0.00 -1.37 -0.14 0.00 0.77 0.00 0.00 66.41 65.67 2e1c h THR 57 Cb 0.33 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 2e1c h THR 57 CO 0.02 0.45 -0.27 0.40 0.37 0.00 0.00 175.52 176.49 2e1c h ILE 58 N 0.53 1.27 -0.58 3.11 1.08 -0.77 -1.66 117.51 120.49 2e1c h ILE 58 Ca 0.07 -1.43 0.05 0.00 -0.39 0.00 0.00 64.86 63.16 2e1c h ILE 58 Cb 0.78 1.24 -0.05 0.00 -3.07 0.00 0.00 36.82 35.72 2e1c h ILE 58 CO 0.06 0.48 0.31 -0.74 -0.69 0.00 0.00 178.15 177.57 2e1c h HIS 59 N 0.76 0.57 -0.39 1.37 2.76 -0.83 0.13 115.15 119.51 2e1c h HIS 59 Ca 0.09 0.02 -0.12 0.00 -2.20 0.00 0.00 60.37 58.16 2e1c h HIS 59 Cb 0.83 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.62 2e1c h HIS 59 CO 0.05 0.27 -0.23 1.49 -1.30 0.00 0.00 177.93 178.21 2e1c h GLU 60 N 0.58 0.85 -0.41 5.26 4.57 -1.22 -1.48 114.58 122.75 2e1c h GLU 60 Ca 0.26 -0.39 0.05 0.00 -1.18 0.00 0.00 59.36 58.10 2e1c h GLU 60 Cb 0.16 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.69 2e1c h GLU 60 CO -0.17 1.03 0.15 0.00 -1.18 0.00 0.00 179.01 178.84 2e1c h ARG 61 N 0.66 0.31 -0.60 1.92 2.47 -0.66 -0.85 114.38 117.62 2e1c h ARG 61 Ca 0.08 -0.02 -0.09 0.00 -1.26 0.00 0.00 59.98 58.69 2e1c h ARG 61 Cb 0.80 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 29.03 2e1c h ARG 61 CO 0.07 0.20 0.01 0.82 0.56 0.00 0.00 179.97 181.64 2e1c h ILE 62 N 0.32 1.27 -0.39 2.04 2.04 -0.93 0.02 117.51 121.87 2e1c h ILE 62 Ca 0.19 -1.13 0.04 0.00 1.00 0.00 0.00 64.86 64.96 2e1c h ILE 62 Cb 0.16 0.80 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 2e1c h ILE 62 CO -0.18 0.41 0.15 -0.09 0.00 0.00 0.00 178.15 178.44 2e1c h ARG 63 N 0.95 0.31 -0.54 2.37 2.43 -0.74 -0.15 114.38 119.01 2e1c h ARG 63 Ca 0.17 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 2e1c h ARG 63 Cb 0.54 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 2e1c h ARG 63 CO 0.03 0.20 -0.01 0.87 -1.51 0.00 0.00 179.97 179.55 2e1c h LYS 64 N 0.32 0.92 -0.23 0.20 1.57 -0.86 -0.32 116.57 118.17 2e1c h LYS 64 Ca 0.17 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 2e1c h LYS 64 Cb 0.14 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2e1c h LYS 64 CO -0.17 0.92 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.47 2e1c h LEU 65 N 0.85 0.35 -0.06 2.94 3.38 -0.40 -1.25 115.31 121.12 2e1c h LEU 65 Ca 0.16 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 2e1c h LEU 65 Cb 0.51 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.18 2e1c h LEU 65 CO 0.03 0.49 -0.61 0.03 0.09 0.00 0.00 178.44 178.46 2e1c h ARG 66 N 0.35 0.51 -0.47 1.13 3.08 -0.62 -1.13 114.38 117.23 2e1c h ARG 66 Ca 0.07 -0.48 0.02 0.00 0.07 0.00 0.00 59.98 59.66 2e1c h ARG 66 Cb 0.39 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 2e1c h ARG 66 CO 0.02 1.11 0.29 0.93 -1.07 0.00 0.00 179.97 181.25 2e1c h GLU 67 N 0.09 0.56 0.00 0.04 5.08 -0.74 -2.26 114.58 117.35 2e1c h GLU 67 Ca -0.06 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2e1c h GLU 67 Cb 1.28 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2e1c h GLU 67 CO 0.12 0.37 0.00 -1.13 -1.00 0.00 0.00 179.01 177.37 2e1c n SER 68 N -4.81 0.00 0.00 1.42 3.41 -0.50 -4.90 113.62 108.25 2e1c n SER 68 Ca 0.02 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 2e1c n SER 68 Cb 0.06 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 2e1c n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e1c n GLY 69 N 0.75 1.14 0.10 5.00 0.00 -0.85 -4.92 105.19 106.40 2e1c n GLY 69 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 2e1c n GLY 69 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2e1c h VAL 70 N 0.00 0.86 -3.56 1.61 2.07 -1.49 -3.28 116.25 112.47 2e1c h VAL 70 Ca 0.00 -0.01 -0.68 0.00 0.82 0.00 0.00 66.70 66.83 2e1c h VAL 70 Cb 0.00 0.82 -0.17 0.00 -1.52 0.00 0.00 31.29 30.41 2e1c h VAL 70 CO 0.00 0.01 -0.11 -0.63 0.02 0.00 0.00 177.57 176.86 2e1c s ILE 71 N -6.19 5.01 0.22 4.57 1.01 -0.72 -4.93 121.20 120.17 2e1c s ILE 71 Ca -0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 60.65 60.35 2e1c s ILE 71 Cb 0.09 -4.08 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 2e1c s ILE 71 CO 0.68 -0.45 1.55 0.11 0.00 0.00 0.00 174.94 176.83 2e1c h LYS 72 N 8.75 0.46 0.00 2.79 1.57 -1.88 -3.40 116.57 124.86 2e1c h LYS 72 Ca -0.26 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 2e1c h LYS 72 Cb 1.11 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2e1c h LYS 72 CO 0.82 0.87 0.00 0.36 -0.57 0.00 0.00 179.45 180.92 2e1c n LYS 73 N -3.96 0.00 -4.29 3.15 2.85 -1.26 -5.07 118.16 109.58 2e1c n LYS 73 Ca -0.03 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.89 2e1c n LYS 73 Cb 0.58 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.87 2e1c n LYS 73 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2e1c s PHE 74 N -2.00 3.20 0.12 5.58 0.40 -1.26 -5.11 117.98 118.92 2e1c s PHE 74 Ca 0.00 0.21 -0.21 0.00 -0.60 0.00 0.00 56.93 56.34 2e1c s PHE 74 Cb 0.00 -1.79 0.06 0.00 0.51 0.00 0.00 43.02 41.80 2e1c s PHE 74 CO 0.00 0.50 0.52 -0.08 0.70 0.00 0.00 175.22 176.86 2e1c s THR 75 N -0.95 0.03 -0.20 0.64 -1.32 -1.26 -5.13 115.64 107.45 2e1c s THR 75 Ca 0.15 -0.23 -0.13 0.00 -1.21 0.00 0.00 61.69 60.27 2e1c s THR 75 Cb -0.11 -1.05 -0.04 0.00 -1.51 0.00 0.00 72.50 69.78 2e1c s THR 75 CO 0.04 -0.13 0.28 0.00 -2.21 0.00 0.00 174.62 172.61 2e1c s ALA 76 N -3.49 3.59 -0.24 11.08 0.00 -1.26 -4.98 121.76 126.47 2e1c s ALA 76 Ca 0.00 -0.62 -0.23 0.00 0.00 0.00 0.00 51.96 51.11 2e1c s ALA 76 Cb 0.00 -2.45 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 2e1c s ALA 76 CO -0.10 -0.13 0.76 0.42 0.00 0.00 0.00 175.76 176.70 2e1c s ILE 77 N 0.95 4.90 -0.08 0.00 -1.09 -1.26 -5.04 121.20 119.57 2e1c s ILE 77 Ca 0.14 1.42 -0.05 0.00 -2.23 0.00 0.00 60.65 59.93 2e1c s ILE 77 Cb -0.14 -4.05 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 2e1c s ILE 77 CO 0.05 -0.02 0.13 -0.63 -1.23 0.00 0.00 174.94 173.24 2e1c s ILE 78 N 2.61 5.33 -0.26 2.92 -1.09 -1.26 -5.06 121.20 124.39 2e1c s ILE 78 Ca 0.32 0.03 -0.29 0.00 -2.23 0.00 0.00 60.65 58.48 2e1c s ILE 78 Cb -0.15 -3.37 -0.02 0.00 -1.58 0.00 0.00 42.46 37.34 2e1c s ILE 78 CO 0.08 0.52 1.51 -0.62 -1.23 0.00 0.00 174.94 175.21 2e1c s ASP 79 N -1.30 6.46 0.18 3.58 2.15 -1.26 -4.92 116.67 121.56 2e1c s ASP 79 Ca 0.19 1.44 -0.19 0.00 0.43 0.00 0.00 52.55 54.42 2e1c s ASP 79 Cb -0.12 -2.53 0.12 0.00 -0.30 0.00 0.00 42.92 40.08 2e1c s ASP 79 CO 0.08 -1.22 1.62 -0.65 -0.17 0.00 0.00 175.17 174.83 2e1c h PRO 80 N 10.31 -0.14 -0.47 4.34 0.11 -1.97 -1.86 132.00 142.32 2e1c h PRO 80 Ca -0.31 0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.89 2e1c h PRO 80 Cb 1.13 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 2e1c h PRO 80 CO 1.02 -0.09 0.32 0.93 -0.21 0.00 0.00 178.00 179.96 2e1c h GLU 81 N -0.14 0.26 0.00 1.05 5.08 -1.92 0.13 114.58 119.04 2e1c h GLU 81 Ca 0.21 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2e1c h GLU 81 Cb 0.48 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 2e1c h GLU 81 CO -0.55 0.17 -0.01 0.00 -1.00 0.00 0.00 179.01 177.63 2e1c h ALA 82 N 1.76 1.02 -0.62 3.43 0.00 -1.68 -1.66 119.26 121.51 2e1c h ALA 82 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2e1c h ALA 82 Cb 0.49 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2e1c h ALA 82 CO -0.04 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.50 2e1c n LEU 83 N -3.13 3.69 0.00 0.00 4.77 0.39 -4.94 117.00 117.79 2e1c n LEU 83 Ca -0.01 -1.94 0.00 0.00 -0.03 0.00 0.00 56.01 54.03 2e1c n LEU 83 Cb 0.21 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2e1c n LEU 83 CO 0.25 0.91 0.00 0.61 -1.33 0.00 0.00 177.39 177.83 2e1c n GLY 84 N 1.40 1.03 3.53 -0.72 0.00 -0.62 -4.98 105.19 104.84 2e1c n GLY 84 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 2e1c n GLY 84 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2e1c s TYR 85 N -2.78 3.06 -1.88 1.61 1.51 -0.87 -4.36 117.35 113.63 2e1c s TYR 85 Ca 0.00 -1.80 0.29 0.00 -1.01 0.00 0.00 57.07 54.55 2e1c s TYR 85 Cb 0.00 -4.58 1.28 0.00 -0.11 0.00 0.00 41.96 38.55 2e1c s TYR 85 CO 0.00 -1.65 1.88 -1.13 -1.11 0.00 0.00 175.55 173.54 2e1c n SER 86 N 7.32 0.63 -4.24 2.29 3.41 -1.21 -3.62 113.62 118.21 2e1c n SER 86 Ca 0.43 -0.85 -0.32 0.00 -0.26 0.00 0.00 58.87 57.87 2e1c n SER 86 Cb 0.45 -0.03 -0.16 0.00 -0.26 0.00 0.00 64.21 64.20 2e1c n SER 86 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2e1c s MET 87 N -2.30 3.11 -0.02 4.33 -2.45 -0.75 -5.00 119.30 116.21 2e1c s MET 87 Ca 0.34 -0.83 0.01 0.00 -1.25 0.00 0.00 55.69 53.96 2e1c s MET 87 Cb 0.20 -2.42 0.01 0.00 1.25 0.00 0.00 34.83 33.88 2e1c s MET 87 CO 0.43 0.12 -0.05 -1.17 1.05 0.00 0.00 175.02 175.41 2e1c s LEU 88 N 0.51 1.66 0.13 4.11 2.96 -1.26 -1.17 118.68 125.61 2e1c s LEU 88 Ca -0.13 -0.10 -0.19 0.00 -0.22 0.00 0.00 54.13 53.48 2e1c s LEU 88 Cb -0.17 -0.35 0.05 0.00 0.50 0.00 0.00 46.19 46.22 2e1c s LEU 88 CO 0.05 0.01 0.48 0.00 -1.32 0.00 0.00 176.35 175.57 2e1c s ALA 89 N 0.38 -1.20 -0.08 5.97 0.00 -0.20 -1.58 121.76 125.05 2e1c s ALA 89 Ca -0.04 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.13 2e1c s ALA 89 Cb -0.08 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 2e1c s ALA 89 CO -0.00 -0.67 -0.10 -0.06 0.00 0.00 0.00 175.76 174.93 2e1c s PHE 90 N -3.61 2.85 -0.17 0.00 0.40 0.08 -0.91 117.98 116.62 2e1c s PHE 90 Ca 0.01 -0.16 0.01 0.00 -0.60 0.00 0.00 56.93 56.19 2e1c s PHE 90 Cb 0.01 -1.73 0.03 0.00 0.51 0.00 0.00 43.02 41.83 2e1c s PHE 90 CO -0.11 0.17 -0.15 0.42 0.70 0.00 0.00 175.22 176.26 2e1c s ILE 91 N -0.50 1.70 -0.03 0.64 1.01 0.70 -0.43 121.20 124.30 2e1c s ILE 91 Ca 0.07 -0.78 -0.19 0.00 0.00 0.00 0.00 60.65 59.75 2e1c s ILE 91 Cb -0.12 -1.62 -0.05 0.00 0.01 0.00 0.00 42.46 40.68 2e1c s ILE 91 CO 0.02 0.42 0.53 -0.76 0.00 0.00 0.00 174.94 175.15 2e1c s LEU 92 N 1.42 4.39 -0.06 2.97 1.43 -0.08 -0.79 118.68 127.95 2e1c s LEU 92 Ca 0.04 1.03 0.03 0.00 -1.03 0.00 0.00 54.13 54.20 2e1c s LEU 92 Cb -0.14 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.29 2e1c s LEU 92 CO -0.11 0.11 -0.15 -0.69 0.23 0.00 0.00 176.35 175.75 2e1c s VAL 93 N -0.13 1.30 -0.18 -1.59 1.01 0.31 -1.41 120.40 119.71 2e1c s VAL 93 Ca 0.28 -0.60 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 2e1c s VAL 93 Cb -0.17 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2e1c s VAL 93 CO 0.15 0.39 0.47 -0.54 0.00 0.00 0.00 175.10 175.57 2e1c s LYS 94 N 0.45 4.22 -0.02 2.72 1.02 0.16 -0.71 119.74 127.58 2e1c s LYS 94 Ca -0.12 0.36 0.05 0.00 0.02 0.00 0.00 55.97 56.29 2e1c s LYS 94 Cb -0.15 -3.52 -0.01 0.00 -0.52 0.00 0.00 37.83 33.63 2e1c s LYS 94 CO 0.04 -0.04 -0.17 0.08 -0.92 0.00 0.00 175.35 174.33 2e1c s VAL 95 N 1.29 1.39 0.24 3.17 1.01 -1.26 0.59 120.40 126.83 2e1c s VAL 95 Ca 0.23 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.17 2e1c s VAL 95 Cb -0.15 -1.16 -0.09 0.00 0.00 0.00 0.00 36.38 34.97 2e1c s VAL 95 CO 0.09 0.39 1.31 -0.75 0.00 0.00 0.00 175.10 176.15 2e1c s LYS 96 N -0.35 4.38 0.20 2.72 2.20 0.86 -4.92 119.74 124.83 2e1c s LYS 96 Ca 0.05 2.11 -0.31 0.00 -0.36 0.00 0.00 55.97 57.46 2e1c s LYS 96 Cb -0.07 -3.16 -0.16 0.00 -1.51 0.00 0.00 37.83 32.93 2e1c s LYS 96 CO -0.00 -0.23 1.03 0.00 -0.36 0.00 0.00 175.35 175.79 2e1c n ALA 97 N 2.10 -1.05 -0.34 3.13 0.00 -1.26 -1.66 120.51 121.44 2e1c n ALA 97 Ca 0.04 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.93 2e1c n ALA 97 Cb 0.42 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2e1c n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2e1c n GLY 98 N 1.77 1.64 0.77 0.00 0.00 -1.26 -4.88 105.19 103.23 2e1c n GLY 98 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 2e1c n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e1c n LYS 99 N -2.00 1.81 -0.05 1.61 4.76 -0.66 -4.65 118.16 118.98 2e1c n LYS 99 Ca 0.00 -1.77 -0.08 0.00 -2.87 0.00 0.00 58.31 53.59 2e1c n LYS 99 Cb 0.00 -1.35 -0.02 0.00 -1.84 0.00 0.00 35.03 31.82 2e1c n LYS 99 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 2e1c h TYR 100 N 3.23 -0.03 -0.60 2.13 -1.99 -1.90 -0.98 116.97 116.82 2e1c h TYR 100 Ca 0.00 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.77 2e1c h TYR 100 Cb 0.75 0.05 -0.04 0.00 2.00 0.00 0.00 36.73 39.49 2e1c h TYR 100 CO 0.11 -0.05 0.37 0.77 -0.00 0.00 0.00 178.16 179.37 2e1c h SER 101 N 0.06 0.62 -0.24 3.88 0.02 -1.98 0.25 113.55 116.15 2e1c h SER 101 Ca 0.11 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2e1c h SER 101 Cb 0.14 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2e1c h SER 101 CO -0.19 0.43 0.08 -0.08 -1.14 0.00 0.00 176.83 175.94 2e1c h GLU 102 N 0.74 0.37 -0.17 3.45 4.57 -1.80 -0.38 114.58 121.36 2e1c h GLU 102 Ca 0.24 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2e1c h GLU 102 Cb 0.01 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 2e1c h GLU 102 CO -0.09 0.44 0.05 0.28 -1.18 0.00 0.00 179.01 178.50 2e1c h VAL 103 N 0.23 1.19 -0.07 0.32 2.07 -0.89 -1.43 116.25 117.68 2e1c h VAL 103 Ca 0.08 -0.61 0.02 0.00 0.82 0.00 0.00 66.70 67.01 2e1c h VAL 103 Cb 0.22 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2e1c h VAL 103 CO -0.00 0.19 -0.06 0.00 0.02 0.00 0.00 177.57 177.71 2e1c h ALA 104 N 0.86 -0.00 -0.92 1.67 0.00 -0.46 -0.98 119.26 119.43 2e1c h ALA 104 Ca 0.05 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.07 2e1c h ALA 104 Cb 0.24 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 2e1c h ALA 104 CO -0.00 -0.53 0.60 1.03 0.00 0.00 0.00 179.25 180.35 2e1c h SER 105 N -0.07 0.90 -0.65 0.00 0.87 -1.00 0.40 113.55 114.00 2e1c h SER 105 Ca 0.05 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.60 2e1c h SER 105 Cb 0.14 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 61.90 2e1c h SER 105 CO -0.11 0.55 0.30 -1.13 -0.53 0.00 0.00 176.83 175.91 2e1c h ASN 106 N 1.01 0.86 0.07 6.23 -0.73 -0.40 -3.28 115.58 119.33 2e1c h ASN 106 Ca 0.41 -0.14 -0.11 0.00 1.87 0.00 0.00 56.30 58.33 2e1c h ASN 106 Cb 0.28 -0.22 0.01 0.00 0.27 0.00 0.00 38.32 38.65 2e1c h ASN 106 CO -0.17 0.76 -0.51 -0.07 -0.37 0.00 0.00 177.43 177.08 2e1c h LEU 107 N 0.89 0.22 -1.49 0.34 3.38 -0.23 -3.35 115.31 115.07 2e1c h LEU 107 Ca 0.22 -0.94 0.23 0.00 0.09 0.00 0.00 57.88 57.48 2e1c h LEU 107 Cb 0.14 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2e1c h LEU 107 CO -0.03 1.23 0.89 0.00 0.09 0.00 0.00 178.44 180.63 2e1c h ALA 108 N 0.00 2.62 0.00 1.53 0.00 -0.30 -0.39 119.26 122.72 2e1c h ALA 108 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2e1c h ALA 108 Cb 1.33 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2e1c h ALA 108 CO 0.05 -1.30 0.00 0.36 0.00 0.00 0.00 179.25 178.37 2e1c n LYS 109 N -3.46 0.17 -3.63 0.00 2.85 -1.24 -4.71 118.16 108.14 2e1c n LYS 109 Ca 0.17 0.07 -0.36 0.00 -1.05 0.00 0.00 58.31 57.13 2e1c n LYS 109 Cb 1.15 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 33.95 2e1c n LYS 109 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2e1c s TYR 110 N -2.80 3.38 0.43 5.58 1.51 -0.16 -4.98 117.35 120.31 2e1c s TYR 110 Ca 0.17 0.38 0.22 0.00 -1.01 0.00 0.00 57.07 56.83 2e1c s TYR 110 Cb 0.16 -2.28 1.26 0.00 -0.11 0.00 0.00 41.96 41.00 2e1c s TYR 110 CO 0.42 0.17 2.04 -1.00 -1.11 0.00 0.00 175.55 176.06 2e1c h PRO 111 N 7.04 0.00 0.00 -1.71 0.13 -1.88 -2.19 132.00 133.40 2e1c h PRO 111 Ca -0.39 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.70 2e1c h PRO 111 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2e1c h PRO 111 CO 0.72 0.15 -0.18 0.93 -0.23 0.00 0.00 178.00 179.40 2e1c h GLU 112 N 0.00 0.00 -5.39 0.86 3.07 -1.94 -3.37 114.58 107.81 2e1c h GLU 112 Ca -0.00 0.00 -0.64 0.00 -0.50 0.00 0.00 59.36 58.22 2e1c h GLU 112 Cb 0.33 0.00 -0.15 0.00 -0.84 0.00 0.00 28.75 28.09 2e1c h GLU 112 CO 0.02 0.18 0.46 0.42 -1.40 0.00 0.00 179.01 178.68 2e1c s ILE 113 N -4.34 4.44 -0.31 3.13 1.01 -0.82 -1.05 121.20 123.26 2e1c s ILE 113 Ca -0.03 -0.33 0.23 0.00 0.00 0.00 0.00 60.65 60.51 2e1c s ILE 113 Cb 0.14 -4.60 0.02 0.00 0.01 0.00 0.00 42.46 38.03 2e1c s ILE 113 CO 0.64 -1.31 1.11 -0.37 0.00 0.00 0.00 174.94 175.01 2e1c h VAL 114 N 5.97 0.00 -3.29 2.92 -1.51 -1.42 -3.45 116.25 115.46 2e1c h VAL 114 Ca -0.28 -0.92 -0.20 0.00 -1.23 0.00 0.00 66.70 64.07 2e1c h VAL 114 Cb 1.07 1.45 -0.28 0.00 -2.13 0.00 0.00 31.29 31.40 2e1c h VAL 114 CO 1.14 0.00 -0.54 -1.61 -1.23 0.00 0.00 177.57 175.33 2e1c s GLU 115 N -3.33 0.17 -0.08 5.19 2.02 -1.11 -4.98 118.70 116.58 2e1c s GLU 115 Ca 0.01 0.28 -0.03 0.00 0.02 0.00 0.00 54.97 55.26 2e1c s GLU 115 Cb 0.10 0.01 0.04 0.00 0.10 0.00 0.00 34.13 34.38 2e1c s GLU 115 CO 0.78 -0.07 0.06 0.08 0.02 0.00 0.00 175.26 176.13 2e1c s VAL 116 N 0.43 -0.02 0.05 2.63 1.01 -1.26 -1.29 120.40 121.95 2e1c s VAL 116 Ca -0.03 0.23 0.07 0.00 0.00 0.00 0.00 61.98 62.25 2e1c s VAL 116 Cb -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 2e1c s VAL 116 CO -0.02 0.08 -0.19 -0.31 0.00 0.00 0.00 175.10 174.66 2e1c s TYR 117 N 2.13 1.62 -0.24 5.22 1.51 -0.30 -4.99 117.35 122.31 2e1c s TYR 117 Ca 0.04 -0.38 -0.10 0.00 -1.01 0.00 0.00 57.07 55.62 2e1c s TYR 117 Cb -0.13 -0.95 -0.05 0.00 -0.11 0.00 0.00 41.96 40.72 2e1c s TYR 117 CO -0.05 0.10 0.15 -2.00 -1.11 0.00 0.00 175.55 172.64 2e1c s GLU 118 N -1.32 4.07 0.22 -0.62 2.12 -1.26 -1.06 118.70 120.84 2e1c s GLU 118 Ca 0.05 -0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.11 2e1c s GLU 118 Cb -0.09 -3.52 -0.05 0.00 0.26 0.00 0.00 34.13 30.73 2e1c s GLU 118 CO 0.02 0.08 0.10 0.95 -0.54 0.00 0.00 175.26 175.87 2e1c s THR 119 N 1.01 0.30 0.80 -1.70 -4.23 0.28 -4.98 115.64 107.12 2e1c s THR 119 Ca 0.07 -1.99 -0.07 0.00 -1.18 0.00 0.00 61.69 58.53 2e1c s THR 119 Cb -0.13 -2.49 0.14 0.00 1.34 0.00 0.00 72.50 71.36 2e1c s THR 119 CO 0.04 -0.08 1.11 0.42 -0.54 0.00 0.00 174.62 175.57 2e1c s THR 120 N -3.94 2.12 0.00 3.99 -4.23 -1.26 -4.43 115.64 107.89 2e1c s THR 120 Ca 0.36 -0.35 0.00 0.00 -1.18 0.00 0.00 61.69 60.52 2e1c s THR 120 Cb 0.07 -2.77 0.00 0.00 1.34 0.00 0.00 72.50 71.14 2e1c s THR 120 CO 0.11 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 2e1c n GLY 121 N -3.16 -1.56 0.25 3.99 0.00 -1.26 -4.60 105.19 98.86 2e1c n GLY 121 Ca 0.14 -2.17 0.09 0.00 0.00 0.00 0.00 46.02 44.08 2e1c n GLY 121 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2e1c h ASP 122 N 0.00 0.00 -2.11 1.61 3.32 -2.01 -3.42 116.42 113.80 2e1c h ASP 122 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2e1c h ASP 122 Cb 0.00 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.45 2e1c h ASP 122 CO 0.00 0.11 -0.64 -0.31 -1.72 0.00 0.00 179.24 176.68 2e1c s TYR 123 N -4.59 2.63 -0.04 4.55 1.51 -1.26 -4.93 117.35 115.22 2e1c s TYR 123 Ca -0.04 -0.29 0.19 0.00 -1.01 0.00 0.00 57.07 55.92 2e1c s TYR 123 Cb 0.15 -1.28 -0.29 0.00 -0.11 0.00 0.00 41.96 40.43 2e1c s TYR 123 CO 0.64 0.57 0.42 -0.25 -1.11 0.00 0.00 175.55 175.82 2e1c n ASP 124 N -0.91 0.67 -3.94 2.29 8.00 0.11 -4.51 116.55 118.26 2e1c n ASP 124 Ca -0.05 -0.01 -0.10 0.00 0.71 0.00 0.00 54.79 55.33 2e1c n ASP 124 Cb 0.60 1.85 -0.11 0.00 -0.02 0.00 0.00 41.12 43.44 2e1c n ASP 124 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2e1c s MET 125 N -3.31 0.28 -0.11 -1.24 -1.94 -0.50 -0.56 119.30 111.91 2e1c s MET 125 Ca -0.07 -0.44 0.03 0.00 -1.71 0.00 0.00 55.69 53.50 2e1c s MET 125 Cb 0.12 0.10 0.01 0.00 2.01 0.00 0.00 34.83 37.07 2e1c s MET 125 CO 0.79 -0.05 -0.20 0.08 -0.01 0.00 0.00 175.02 175.62 2e1c s VAL 126 N -1.14 1.87 -0.12 -6.03 1.01 -0.23 -0.53 120.40 115.23 2e1c s VAL 126 Ca -0.12 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.00 2e1c s VAL 126 Cb -0.08 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.66 2e1c s VAL 126 CO -0.00 0.52 -0.21 -0.69 0.00 0.00 0.00 175.10 174.71 2e1c s VAL 127 N 0.69 1.96 -0.23 2.92 1.01 0.03 -1.15 120.40 125.63 2e1c s VAL 127 Ca -0.11 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 2e1c s VAL 127 Cb -0.16 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 2e1c s VAL 127 CO 0.02 0.53 0.12 -0.75 0.00 0.00 0.00 175.10 175.02 2e1c s LYS 128 N 0.68 3.93 0.02 2.72 2.20 -0.41 -0.21 119.74 128.67 2e1c s LYS 128 Ca -0.11 -0.35 0.04 0.00 -0.36 0.00 0.00 55.97 55.20 2e1c s LYS 128 Cb -0.16 -3.43 -0.02 0.00 -1.51 0.00 0.00 37.83 32.72 2e1c s LYS 128 CO 0.02 0.01 -0.13 -1.50 -0.36 0.00 0.00 175.35 173.40 2e1c s ILE 129 N 1.14 0.98 -0.08 5.43 2.07 -0.09 -1.47 121.20 129.17 2e1c s ILE 129 Ca 0.06 -0.80 0.04 0.00 -1.41 0.00 0.00 60.65 58.54 2e1c s ILE 129 Cb -0.14 -0.87 0.00 0.00 0.13 0.00 0.00 42.46 41.58 2e1c s ILE 129 CO 0.04 0.07 -0.21 -0.13 -1.91 0.00 0.00 174.94 172.81 2e1c s ARG 130 N -0.83 2.57 0.15 3.50 0.52 -0.21 -1.03 118.95 123.61 2e1c s ARG 130 Ca 0.02 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2e1c s ARG 130 Cb -0.07 -2.01 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 2e1c s ARG 130 CO 0.01 0.17 0.03 0.95 0.02 0.00 0.00 175.30 176.48 2e1c s THR 131 N 0.33 0.36 0.07 0.02 -4.23 -0.32 -4.63 115.64 107.23 2e1c s THR 131 Ca -0.15 -1.94 0.16 0.00 -1.18 0.00 0.00 61.69 58.58 2e1c s THR 131 Cb -0.16 -2.09 0.08 0.00 1.34 0.00 0.00 72.50 71.66 2e1c s THR 131 CO 0.07 -0.46 1.60 0.11 -0.54 0.00 0.00 174.62 175.39 2e1c h LYS 132 N 2.78 0.00 -3.22 3.99 1.57 -1.86 -1.99 116.57 117.83 2e1c h LYS 132 Ca -0.36 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.38 2e1c h LYS 132 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2e1c h LYS 132 CO 0.61 0.48 0.16 0.54 -0.57 0.00 0.00 179.45 180.67 2e1c s ASN 133 N -6.48 0.10 0.37 0.86 2.20 -1.26 -4.13 114.94 106.59 2e1c s ASN 133 Ca 0.01 -1.09 0.18 0.00 -0.94 0.00 0.00 52.86 51.02 2e1c s ASN 133 Cb 0.10 0.78 0.67 0.00 -2.00 0.00 0.00 41.25 40.80 2e1c s ASN 133 CO 0.72 -1.53 1.74 0.77 -2.94 0.00 0.00 177.10 175.86 2e1c h SER 134 N 2.03 0.00 -0.41 3.54 4.64 -1.98 -2.63 113.55 118.74 2e1c h SER 134 Ca -0.29 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.99 2e1c h SER 134 Cb 1.25 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 2e1c h SER 134 CO 0.37 0.39 0.09 -0.08 -0.87 0.00 0.00 176.83 176.73 2e1c h GLU 135 N 0.00 0.66 -0.61 4.77 4.81 -1.99 0.18 114.58 122.40 2e1c h GLU 135 Ca -0.00 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.00 2e1c h GLU 135 Cb 0.89 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 2e1c h GLU 135 CO 0.05 0.68 0.15 1.49 -0.73 0.00 0.00 179.01 180.65 2e1c h GLU 136 N 0.52 0.98 -0.84 1.92 4.81 -1.95 -1.60 114.58 118.42 2e1c h GLU 136 Ca 0.13 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 2e1c h GLU 136 Cb 0.32 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 2e1c h GLU 136 CO 0.00 0.90 0.48 1.25 -0.73 0.00 0.00 179.01 180.91 2e1c h LEU 137 N 0.89 1.02 -1.14 1.64 5.85 -1.08 -1.91 115.31 120.58 2e1c h LEU 137 Ca 0.19 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 2e1c h LEU 137 Cb 0.36 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2e1c h LEU 137 CO 0.00 0.80 -0.15 0.78 -0.34 0.00 0.00 178.44 179.54 2e1c h ASN 138 N 1.15 0.41 -0.58 1.25 2.35 -0.26 -0.95 115.58 118.96 2e1c h ASN 138 Ca 0.30 -0.11 -0.05 0.00 -0.55 0.00 0.00 56.30 55.89 2e1c h ASN 138 Cb -0.01 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 2e1c h ASN 138 CO -0.05 0.59 0.17 0.78 -1.65 0.00 0.00 177.43 177.27 2e1c h ASN 139 N 0.39 0.85 -0.26 5.81 2.35 -0.56 -0.73 115.58 123.44 2e1c h ASN 139 Ca 0.07 -0.22 -0.07 0.00 -0.55 0.00 0.00 56.30 55.54 2e1c h ASN 139 Cb 0.50 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 2e1c h ASN 139 CO 0.03 0.84 -0.06 -0.26 -1.65 0.00 0.00 177.43 176.34 2e1c h PHE 140 N 0.82 0.67 -0.59 1.19 -1.00 -0.88 -0.47 116.94 116.68 2e1c h PHE 140 Ca 0.19 -0.09 -0.07 0.00 2.81 0.00 0.00 57.97 60.80 2e1c h PHE 140 Cb 0.30 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 39.66 2e1c h PHE 140 CO 0.02 0.68 0.08 -0.07 -1.61 0.00 0.00 178.31 177.40 2e1c h LEU 141 N 0.59 0.95 -0.75 1.54 3.38 -0.74 0.69 115.31 120.97 2e1c h LEU 141 Ca 0.11 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 2e1c h LEU 141 Cb 0.46 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2e1c h LEU 141 CO 0.02 0.98 0.22 0.44 0.09 0.00 0.00 178.44 180.20 2e1c h ASP 142 N 0.88 1.10 0.31 -0.43 3.32 -0.74 -1.54 116.42 119.32 2e1c h ASP 142 Ca 0.18 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 2e1c h ASP 142 Cb 0.45 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2e1c h ASP 142 CO 0.02 1.02 -0.15 0.25 -1.72 0.00 0.00 179.24 178.66 2e1c h LEU 143 N 1.12 -0.35 -0.45 1.55 5.85 -0.64 -2.37 115.31 120.02 2e1c h LEU 143 Ca 0.24 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.92 2e1c h LEU 143 Cb 0.32 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 2e1c h LEU 143 CO -0.01 -0.12 0.17 0.40 -0.34 0.00 0.00 178.44 178.54 2e1c h ILE 144 N -0.58 0.87 0.00 4.05 2.04 -0.79 -1.20 117.51 121.90 2e1c h ILE 144 Ca -0.04 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.70 2e1c h ILE 144 Cb 0.42 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2e1c h ILE 144 CO 0.07 0.06 0.00 1.23 0.00 0.00 0.00 178.15 179.51 2e1c h GLY 145 N 0.34 0.00 0.86 5.37 0.00 -1.27 -2.67 103.07 105.70 2e1c h GLY 145 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2e1c h GLY 145 CO -0.20 0.00 -0.56 -1.14 0.00 0.00 0.00 176.54 174.64 2e1c n SER 146 N -2.81 0.57 -4.73 0.19 3.41 -0.49 -4.88 113.62 104.89 2e1c n SER 146 Ca 0.00 -0.36 -0.42 0.00 -0.26 0.00 0.00 58.87 57.84 2e1c n SER 146 Cb 0.22 0.34 -0.03 0.00 -0.26 0.00 0.00 64.21 64.48 2e1c n SER 146 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2e1c s ILE 147 N -2.99 3.20 0.04 -1.33 1.01 -1.01 -4.93 121.20 115.20 2e1c s ILE 147 Ca 0.11 0.92 -0.30 0.00 0.00 0.00 0.00 60.65 61.38 2e1c s ILE 147 Cb 0.17 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.96 2e1c s ILE 147 CO 0.72 0.10 1.97 -2.65 0.00 0.00 0.00 174.94 175.09 2e1c n PRO 148 N 3.28 2.87 0.00 2.79 -0.02 -1.26 -1.49 135.00 141.18 2e1c n PRO 148 Ca 0.09 1.05 0.00 0.00 -2.02 0.00 0.00 63.50 62.62 2e1c n PRO 148 Cb 0.42 -3.01 0.00 0.00 -0.02 0.00 0.00 33.50 30.89 2e1c n PRO 148 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2e1c n GLY 149 N 4.54 2.26 3.67 -1.23 0.00 -1.26 -4.85 105.19 108.31 2e1c n GLY 149 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2e1c n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2e1c s VAL 150 N -2.10 4.87 -1.88 1.61 1.01 -0.55 -0.10 120.40 123.26 2e1c s VAL 150 Ca 0.00 1.62 0.21 0.00 0.00 0.00 0.00 61.98 63.81 2e1c s VAL 150 Cb 0.00 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 2e1c s VAL 150 CO 0.00 0.01 1.03 -0.62 0.00 0.00 0.00 175.10 175.52 2e1c n GLU 151 N 5.37 1.25 0.00 2.72 1.02 0.20 -4.88 120.64 126.32 2e1c n GLU 151 Ca 0.05 -0.92 0.00 0.00 -0.02 0.00 0.00 57.16 56.27 2e1c n GLU 151 Cb 0.49 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 2e1c n GLU 151 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2e1c n GLY 152 N 1.38 2.41 3.19 0.62 0.00 -1.20 -4.91 105.19 106.68 2e1c n GLY 152 Ca 0.08 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 45.14 2e1c n GLY 152 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e1c s THR 153 N -2.00 0.13 -0.08 2.61 -4.23 -1.26 -0.67 115.64 110.15 2e1c s THR 153 Ca 0.00 -1.57 -0.03 0.00 -1.18 0.00 0.00 61.69 58.91 2e1c s THR 153 Cb 0.00 -1.68 0.04 0.00 1.34 0.00 0.00 72.50 72.21 2e1c s THR 153 CO 0.00 -0.61 0.15 -2.28 -0.54 0.00 0.00 174.62 171.34 2e1c s HIS 154 N -3.95 -0.16 -0.11 3.99 5.04 -0.50 -4.97 115.29 114.63 2e1c s HIS 154 Ca 0.13 0.55 -0.12 0.00 -1.54 0.00 0.00 55.06 54.09 2e1c s HIS 154 Cb 0.06 -0.21 -0.05 0.00 0.04 0.00 0.00 32.58 32.42 2e1c s HIS 154 CO -0.05 -0.23 0.28 0.99 -2.34 0.00 0.00 174.74 173.38 2e1c s THR 155 N 1.92 5.29 -0.33 0.89 2.01 -1.26 -0.90 115.64 123.25 2e1c s THR 155 Ca -0.01 0.52 0.01 0.00 0.31 0.00 0.00 61.69 62.52 2e1c s THR 155 Cb -0.12 -3.58 0.10 0.00 0.01 0.00 0.00 72.50 68.91 2e1c s THR 155 CO -0.06 0.51 0.10 -0.04 -0.69 0.00 0.00 174.62 174.44 2e1c s MET 156 N -0.39 0.97 0.00 4.92 -1.94 0.43 -5.00 119.30 118.29 2e1c s MET 156 Ca 0.18 -1.38 -0.28 0.00 -1.71 0.00 0.00 55.69 52.50 2e1c s MET 156 Cb -0.14 -2.36 -0.04 0.00 2.01 0.00 0.00 34.83 34.31 2e1c s MET 156 CO 0.06 -0.99 0.91 0.42 -0.01 0.00 0.00 175.02 175.42 2e1c s ILE 157 N 1.31 4.85 -0.14 2.53 1.01 -1.26 -0.74 121.20 128.76 2e1c s ILE 157 Ca 0.11 1.92 -0.29 0.00 0.00 0.00 0.00 60.65 62.39 2e1c s ILE 157 Cb -0.18 -4.26 -0.02 0.00 0.01 0.00 0.00 42.46 38.01 2e1c s ILE 157 CO -0.19 0.21 1.24 -0.69 0.00 0.00 0.00 174.94 175.51 2e1c s VAL 158 N 0.79 4.29 -0.09 2.92 1.01 -0.62 -4.90 120.40 123.81 2e1c s VAL 158 Ca 0.48 1.58 0.08 0.00 0.00 0.00 0.00 61.98 64.12 2e1c s VAL 158 Cb -0.21 -4.02 -0.24 0.00 0.00 0.00 0.00 36.38 31.92 2e1c s VAL 158 CO 0.26 -0.11 0.50 0.18 0.00 0.00 0.00 175.10 175.93 2e1c n LEU 159 N 6.27 1.27 -3.68 3.92 4.77 -1.26 -4.74 117.00 123.54 2e1c n LEU 159 Ca 0.13 0.30 -0.14 0.00 -0.03 0.00 0.00 56.01 56.28 2e1c n LEU 159 Cb 0.45 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.32 2e1c n LEU 159 CO 0.55 0.53 0.24 -0.75 -1.33 0.00 0.00 177.39 176.63 2e1c s LYS 160 N -2.57 0.66 -0.34 3.23 2.20 -1.26 -5.13 119.74 116.53 2e1c s LYS 160 Ca -0.10 0.70 -0.12 0.00 -0.36 0.00 0.00 55.97 56.09 2e1c s LYS 160 Cb 0.07 0.32 -0.00 0.00 -1.51 0.00 0.00 37.83 36.71 2e1c s LYS 160 CO 0.80 -0.09 0.22 0.99 -0.36 0.00 0.00 175.35 176.91 2e1c s THR 161 N 0.16 5.00 -0.14 3.43 2.01 -1.26 -4.94 115.64 119.89 2e1c s THR 161 Ca -0.01 -0.40 0.18 0.00 0.31 0.00 0.00 61.69 61.77 2e1c s THR 161 Cb -0.04 -3.61 -0.11 0.00 0.01 0.00 0.00 72.50 68.75 2e1c s THR 161 CO 0.01 -0.05 0.86 1.41 -0.69 0.00 0.00 174.62 176.16 2e1c n HIS 162 N 5.06 0.97 -3.63 4.92 -0.00 -1.26 -4.94 115.22 116.35 2e1c n HIS 162 Ca -0.13 0.31 -0.12 0.00 -0.00 0.00 0.00 57.72 57.79 2e1c n HIS 162 Cb 0.49 -1.06 -0.07 0.00 -0.00 0.00 0.00 29.99 29.35 2e1c n HIS 162 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.34 176.55 2e1c s LYS 163 N -3.02 0.71 -0.30 -0.41 2.20 -1.26 -5.14 119.74 112.52 2e1c s LYS 163 Ca -0.03 0.77 -0.01 0.00 -0.36 0.00 0.00 55.97 56.35 2e1c s LYS 163 Cb 0.09 0.34 0.19 0.00 -1.51 0.00 0.00 37.83 36.94 2e1c s LYS 163 CO 0.81 -0.10 0.66 -2.00 -0.36 0.00 0.00 175.35 174.36 2e1c s GLU 164 N 0.19 0.51 0.06 4.03 2.12 -1.26 -5.17 118.70 119.19 2e1c s GLU 164 Ca 0.01 0.82 0.00 0.00 0.36 0.00 0.00 54.97 56.16 2e1c s GLU 164 Cb -0.05 0.45 -0.04 0.00 0.26 0.00 0.00 34.13 34.75 2e1c s GLU 164 CO -0.01 -0.65 -0.05 -0.08 -0.54 0.00 0.00 175.26 173.93 2e1c s THR 165 N 2.87 0.39 -0.78 -1.70 -1.32 -1.26 -5.03 115.64 108.81 2e1c s THR 165 Ca 0.17 -1.73 0.14 0.00 -1.21 0.00 0.00 61.69 59.06 2e1c s THR 165 Cb -0.13 -1.41 -0.13 0.00 -1.51 0.00 0.00 72.50 69.31 2e1c s THR 165 CO -0.21 -0.87 0.64 0.35 -2.21 0.00 0.00 174.62 172.32 2e1c n THR 166 N 0.27 0.00 -2.44 5.08 -2.24 -1.26 -4.98 114.28 108.70 2e1c n THR 166 Ca -0.15 -0.19 -0.41 0.00 -2.27 0.00 0.00 64.05 61.03 2e1c n THR 166 Cb 0.60 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 2e1c n THR 166 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2e1c s GLU 167 N -2.28 4.50 -0.03 -0.78 2.02 -1.26 -5.03 118.70 115.84 2e1c s GLU 167 Ca 0.06 1.78 -0.05 0.00 0.02 0.00 0.00 54.97 56.78 2e1c s GLU 167 Cb 0.11 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.00 2e1c s GLU 167 CO 0.56 -0.10 0.20 -0.51 0.02 0.00 0.00 175.26 175.43 2e1c s LEU 168 N 0.23 4.38 0.34 1.80 1.43 -1.26 -5.07 118.68 120.53 2e1c s LEU 168 Ca 0.54 0.47 -0.28 0.00 -1.03 0.00 0.00 54.13 53.82 2e1c s LEU 168 Cb -0.30 -2.48 -0.10 0.00 0.03 0.00 0.00 46.19 43.34 2e1c s LEU 168 CO 0.33 0.30 1.23 -2.16 0.23 0.00 0.00 176.35 176.28 2e1c s PRO 169 N -1.61 4.35 0.00 1.29 0.04 -1.26 -5.05 135.00 132.76 2e1c s PRO 169 Ca 0.24 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.31 2e1c s PRO 169 Cb -0.13 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.41 2e1c s PRO 169 CO 0.14 -0.13 0.18 -0.89 0.04 0.00 0.00 177.00 176.34